SCHEMBL26339974

SCHEMBL26339974

COc1nc(-c2cccc(-c3cccc(-c4cnc(CN5CCC(O)C5)c(OC)n4)c3Cl)c2Cl)cnc1CN

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDCD1 Q15116 20/20 1.00
▸ CD274 Q9NZQ7 20/20 1.00

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL21291132 1.00 PDCD1 (1.00) PDCD1CD274
SCHEMBL21291123 1.00 PDCD1 (1.00) PDCD1CD274
SCHEMBL21290639 0.95 PDCD1 (1.00) PDCD1CD274
SCHEMBL21290647 0.95 PDCD1 (1.00) PDCD1CD274
SCHEMBL26331533 0.95 PDCD1 (1.00) PDCD1CD274
SCHEMBL21290984 0.92 PDCD1 (1.00) PDCD1CD274
SCHEMBL26318850 0.91 PDCD1 (0.91) PDCD1CD274
SCHEMBL26320060 0.90 PDCD1 (0.89) PDCD1CD274
SCHEMBL21291131 0.88 CD274 (1.00) PDCD1CD274
SCHEMBL21290633 0.87 PDCD1 (1.00) PDCD1CD274

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4227302-A1 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2023-08-16 — — EP disclosed
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